N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-2-(4-bromonaphthalen-1-yl)acetamide

Formula:C28H22N3OBr Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-2-(4-bromonaphthalen-1-yl)acetamide is not a drug-like molecule.

MolName	N-[(Z)-(1-benzylindol-3-yl)methylideneamino]-2-(4-bromonaphthalen-1-yl)acetamide
MolecularFormula	C28H22N3OBr
Smiles	O=C(Cc(c1ccccc11)ccc1Br)N/N=C\c1cn(Cc2ccccc2)c2c1cccc2
InChI	InChI=1S/C28H22BrN3O/c29-26-15-14-21(23-10-4-5-12-25(23)26)16-28(33)31-30-17-22-19-32(18-20-8-2-1-3-9-20)27-13-7-6-11-24(22)27/h1-15,17,19H,16,18H2,(H,31,33)
InChIK	ICSIXKSTPOKPFP-UHFFFAOYSA-N
TotalMolweight	496.407
Molweight	496.407
MonoisotopicMass	495.094623
CLogP	6.649
CLogS	-7.104
H Acceptors	4
H Donors	1
TotalSurfaceArea	351.3
Relative PSA	0.12206
PolarSurfaceArea	46.39
Druglikeness	4.2896
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	25
Sp3Atoms	2
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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